SCHEMBL13639595

SCHEMBL13639595

NC1CN[C@@H](C(=O)NCC[C@H](O)CO)[C@@H]1c1cccc(Cl)c1F

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 18/20 0.50
TP53 P04637 2/20 0.37
MDM4 O15151 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13639518 0.78 MDM2 (0.55) MDM2TP53MDM4
SCHEMBL13639519 0.78 MDM2 (0.55) MDM2TP53MDM4
SCHEMBL13639552 0.78 MDM2 (0.49) MDM2TP53MDM4
SCHEMBL13639561 0.77 MDM2 (0.51) MDM2TP53MDM4
SCHEMBL13639560 0.77 MDM2 (0.49) MDM2TP53MDM4
SCHEMBL13639567 0.77 MDM2 (0.51) MDM2TP53MDM4
SCHEMBL8223105 0.74 MDM2 (0.41) MDM2TP53
SCHEMBL13639669 0.74 MDM2 (0.48) MDM2TP53MDM4
SCHEMBL7942102 0.73 MDM2 (0.61) MDM2TP53
SCHEMBL13639671 0.71 MDM2 (0.45) MDM2TP53MDM4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2340021-B1 SUBSTITUTED PYRROLIDINE-2-CARBOXAMIDES HOFFMANN LA ROCHE (CH) 2012-11-07 EP disclosed